[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] 3-dodecylsulfanylpropanoate

Systemtic Name: [2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] 3-dodecylsulfanylpropanoate Openeye Name: [3-hydroxy-2,2-bis(hydroxymethyl)propyl] 3-dodecylsulfanylpropanoate CAS Name: 3-(dodecylthio)propanoic acid [3-hydroxy-2,2-bis(hydroxymethyl)propyl] ester IUPAC Name: [3-hydroxy-2,2-bis(hydroxymethyl)propyl] 3-dodecylsulfanylpropanoate Traditional Name: 3-(laurylthio)propionic acid (3-hydroxy-2,2-dimethylol-propyl) ester Formula: C20H40O5S MolecularWeight: 392.5936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCC(=O)OCC(CO)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCSCCC(=O)OCC(CO)(CO)CO

InChI

InChI=1S/C20H40O5S/c1-2-3-4-5-6-7-8-9-10-11-13-26-14-12-19(24)25-18-20(15-21,16-22)17-23/h21-23H,2-18H2,1H3